CHEBI:162848 - Glu-Gln-Cys

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ChEBI Name Glu-Gln-Cys
ChEBI ID CHEBI:162848
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C13H22N4O7S
Net Charge 0
Average Mass 378.400
Monoisotopic Mass 378.12092
InChI InChI=1S/C13H22N4O7S/c14-6(1-4-10(19)20)11(21)16-7(2-3-9(15)18)12(22)17-8(5-25)13(23)24/h6-8,25H,1-5,14H2,(H2,15,18)(H,16,21)(H,17,22)(H,19,20)(H,23,24)/t6-,7-,8-/m0/s1
InChIKey XMVLTPMCUJTJQP-FXQIFTODSA-N
SMILES SC[C@H](NC(=O)[C@@H](NC(=O)[C@@H](N)CCC(O)=O)CCC(=O)N)C(O)=O
Roles Classification
Chemical Role(s): Bronsted base
A molecular entity capable of accepting a hydron from a donor (Bronsted acid).
(via organic amino compound )
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ChEBI Ontology
Outgoing Glu-Gln-Cys (CHEBI:162848) is a peptide (CHEBI:16670)
IUPAC Name
(4S)-4-amino-5-[[(2S)-5-amino-1-[[(1R)-1-carboxy-2-sulanylethyl]amino]-1,5-dioxopentan-2-yl]amino]-5-oxopentanoic acid